Cas no 85616-27-9 (1-Butanone, 1-(2-amino-4-thiazolyl)-3-methyl-)
85616-27-9 structure
Product Name:1-Butanone, 1-(2-amino-4-thiazolyl)-3-methyl-
CAS No:85616-27-9
MF:C8H12N2OS
MW:184.258680343628
CID:2133184
Update Time:2023-11-18
1-Butanone, 1-(2-amino-4-thiazolyl)-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1-(2-amino-4-thiazolyl)-3-methyl-1-Butanone
- 1-(2-amino-1,3-thiazol-4-yl)-3-methylbutan-1-one
- CID 13040577
- 1-Butanone, 1-(2-amino-4-thiazolyl)-3-methyl-
-
- Inchi： 1S/C8H12N2OS/c1-5(2)3-7(11)6-4-12-8(9)10-6/h4-5H,3H2,1-2H3,(H2,9,10)
- InChI Key： BCHQZCKKPWPPSI-UHFFFAOYSA-N
- SMILES： S1C(N)=NC(=C1)C(CC(C)C)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 172
- Topological Polar Surface Area: 84.2
Experimental Properties
- Density: 1.182±0.06 g/cm3(Predicted)
- Boiling Point: 323.4±15.0 °C(Predicted)
- pka: 2.38±0.10(Predicted)
1-Butanone, 1-(2-amino-4-thiazolyl)-3-methyl- Related Literature
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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4. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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